Geometry & MOs

Info

ID:	158163
PubChem CID:	56463083
Reduced:	N3O4C24H33 (1)
Stoich.:	A3B4C24D33 (1)
Weight, g/mol:	448.222289
ΔH_f, kcal/mol:	-101.36
Dipole, Da:	5.75
IP(EA), eV:	-9.29(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyano-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-5-(1,3-dimethylbenzimidazol-2-ylidene)-4-oxopentanamide

Drug info:

PubChemData

Smile

CCCCCOC1=CC=C(C=C1)C(=O)CCC(=O)NC(C2=NC(=NO2)C3CC3)C(C)C

DOS

IR

Vibrations